Glycoside
GD023604
Name:
NoneFormula:
C13H17O4N3Smiles:
COC[C@@H]1O[C@H](n2ccc3c(C)ncnc32)[C@H](O)[C@H]1OAglycone:
Cc1ncnc2c1C=C[N]2Sugarmoiety:
COCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 279.3 | Num_heavy_atoms: | 20 |
| TPSA: | 89.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD00535
Formula: C7H6N3
Smiles:
Cc1ncnc2c1C=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 132.15 | Num_heavy_atoms: | 10 |
| TPSA: | 39.88 | NumAromaticRings: | 1 |
